3-(4-methylphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]-2,1-benzoxazole-5-carboxamide

Systemtic Name: 3-(4-methylphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]-2,1-benzoxazole-5-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-(p-tolyl)-2,1-benzoxazole-5-carboxamide CAS Name: 3-(4-methylphenyl)-N-[1-(phenylmethyl)-4-piperidinyl]-2,1-benzoxazole-5-carboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-(4-methylphenyl)-2,1-benzoxazole-5-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-(p-tolyl)anthranil-5-carboxamide Formula: C27H27N3O2 MolecularWeight: 425.52218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C27H27N3O2/c1-19-7-9-21(10-8-19)26-24-17-22(11-12-25(24)29-32-26)27(31)28-23-13-15-30(16-14-23)18-20-5-3-2-4-6-20/h2-12,17,23H,13-16,18H2,1H3,(H,28,31)